| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013481
BDB013481
|
US10144731, Example 109
COC(=O)CC(c1ccc(C)c(CN2CCN(C)c3ccccc3S2(=O)=O)c1)c1ccc2c(nnn2C)c1C
|
C29H33N5O4S 547.681000 |
UQZOVMSFIABCOG-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304810; PubChem:CID118188758
|
Local ready
Direct docking supported
|
|
E3L013482
BDB013482
|
US10144731, Example 111
Cc1ccc(C(CC(=O)OC2CCCN(C)C2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C34H42N6O4S 630.815000 |
XHLFTXPROSAUAI-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304811; PubChem:CID118170677
|
Local ready
Direct docking supported
|
|
E3L013483
BDB013483
|
US10144731, Example 112
Cc1ccc(C(CC(=O)OC[C@@H]2CCCN2C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C34H42N6O4S 630.815000 |
PFCGOQHTVTVEGR-BVOOQYFDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304812; PubChem:CID118188759
|
Local ready
Direct docking supported
|
|
E3L013484
BDB013484
|
US10144731, Example 113
Cc1ccc(C(CC(=O)OCC2CCNC2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C33H40N6O4S 616.788000 |
BGZLVEMQAMFUGJ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304813; PubChem:CID118170493
|
Local ready
Direct docking supported
|
|
E3L013485
BDB013485
|
US10144731, Example 114
Cc1ccc(C(CC(=O)OC2CCN(C)CC2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C34H42N6O4S 630.815000 |
SQYPJRMWUTXJDV-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304814; PubChem:CID118170629
|
Local ready
Direct docking supported
|
|
E3L013486
BDB013486
|
US10144731, Example 116
COc1cc(C(CC(=O)O)c2ccc(C)c(CN(C(C)C)S(=O)(=O)c3ccccc3)c2)cc2nnn(C)c12
|
C28H32N4O5S 536.654000 |
GXKFLWFIKGXVFH-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304816; PubChem:CID118169943
|
Local ready
Direct docking supported
|
|
E3L013487
BDB013487
|
US10144731, Example 117
Cc1c(C(CC(=O)O)c2ccc(C(F)(F)F)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)ccc2c1nnn2C
|
C28H27F3N4O5S 588.608000 |
KJTROJDEHGPKAA-UJONTBEJSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304817; PubChem:CID118170742
|
Local ready
Direct docking supported
|
|
E3L013488
BDB013488
|
US10144731, Example 118
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2Cl)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C27H27ClN4O5S 555.056000 |
KWYMBFUQBRMBQX-OQHSHRKDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304818; PubChem:CID118170151
|
Local ready
Direct docking supported
|
|
E3L013489
BDB013489
|
US10144731, Example 119
Cc1ccc(C(c2ccc3c(c2)nnn3C)C(C)C(=O)O)cc1CN(C)S(=O)(=O)c1ccccc1
|
C26H28N4O4S 492.601000 |
KZOPELYEZBBUIV-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304819; PubChem:CID118170409
|
Local ready
Direct docking supported
|
|
E3L013490
BDB013490
|
US10144731, Example 120
Cc1ccc(C(c2ccc3c(nnn3C)c2C)C(C)C(=O)O)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C29H33N5O4S 547.681000 |
GFARMNLPSPHGIR-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304820; PubChem:CID118170111
|
Local ready
Direct docking supported
|
|
E3L013491
BDB013491
|
US10144731, Example 121
Cc1ccc([C@@H](c2ccc3c(nnn3C)c2C)C(C)C(=O)O)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C29H33N5O4S 547.681000 |
GFARMNLPSPHGIR-OHMHCFLMSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304821; PubChem:CID137554658
|
Local ready
Direct docking supported
|
|
E3L013492
BDB013492
|
US10144731, Example 122
Cc1ccc([C@H](c2ccc3c(nnn3C)c2C)C(C)C(=O)O)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C29H33N5O4S 547.681000 |
GFARMNLPSPHGIR-MQBBKVSDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304822; PubChem:CID137554659
|
Local ready
Direct docking supported
|
|
E3L013493
BDB013493
|
BDBM304823
Cc1ccc(C(CCc2c[nH]nn2)CC(=O)O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C24H28N4O5S 484.578000 |
CHDWDCOIXZPZNY-DUSLRRAJSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304823; PubChem:CID118170630
|
Local ready
Direct docking supported
|
|
E3L013494
BDB013494
|
US10144731, Example 124
Cc1ccc(C(CCc2cn(Cc3ccccc3)nn2)CC(=O)O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C31H34N4O5S 574.703000 |
BOEKOLYWXVRUED-GEPVFLLWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304824; PubChem:CID118188761
|
Local ready
Direct docking supported
|
|
E3L013495
BDB013495
|
US10144731, Example 125
Cc1ccc(C(CCc2cnn(C)n2)CC(=O)O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C25H30N4O5S 498.605000 |
UEORTKJCUOEYPP-QSVWIEALSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304825; PubChem:CID118170725
|
Local ready
Direct docking supported
|
|
E3L013496
BDB013496
|
US10144731, Example 126
Cc1ccc(C(CCc2cn(C)nn2)CC(=O)O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C25H30N4O5S 498.605000 |
XKXXEUFAYDHYPN-QSVWIEALSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304826; PubChem:CID118170463
|
Local ready
Direct docking supported
|
|
E3L013497
BDB013497
|
US10144731, Example 127
CCn1cc(CCC(CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)nn1
|
C26H32N4O5S 512.632000 |
VPBZLUCAQZZNOB-YMBRHYMPSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304827; PubChem:CID118188869
|
Local ready
Direct docking supported
|
|
E3L013498
BDB013498
|
US10144731, Example 128
COc1cc(C(CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccncc4S3(=O)=O)c2)cc2nnn(C)c12
|
C27H29N5O6S 551.625000 |
HPTOTBDEYJWXMS-OQHSHRKDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304828; PubChem:CID118170652
|
Local ready
Direct docking supported
|
|
E3L013499
BDB013499
|
US10144731, Example 129
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2C)cc1CN1C[C@@H](C)Oc2ccncc2S1(=O)=O
|
C27H29N5O5S 535.626000 |
BYWWNBFIESJIJW-PLEWWHCXSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304829; PubChem:CID118170968
|
Local ready
Direct docking supported
|
|
E3L013500
BDB013500
|
US10144731, Example 130
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2C(F)(F)F)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C28H27F3N4O5S 588.608000 |
UNBMJIHNTHTIKI-OQHSHRKDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304830; PubChem:CID118170597
|
Local ready
Direct docking supported
|